Cas no 150438-06-5 (1H-Imidazole-4-carbonitrile,5-amino-2-propyl-)

1H-Imidazole-4-carbonitrile,5-amino-2-propyl- structure
150438-06-5 structure
Product Name:1H-Imidazole-4-carbonitrile,5-amino-2-propyl-
CAS No:150438-06-5
MF:C7H10N4
MW:150.1811003685
CID:99884
PubChem ID:22011301
Update Time:2025-04-18

1H-Imidazole-4-carbonitrile,5-amino-2-propyl- Chemical and Physical Properties

Names and Identifiers

    • 1H-Imidazole-4-carbonitrile,5-amino-2-propyl-
    • 1H-Imidazole-4-carbonitrile,5-amino-2-propyl-(9CI)
    • SCHEMBL7232841
    • 150438-06-5
    • 4-amino-2-propyl-1H-imidazole-5-carbonitrile
    • Inchi: 1S/C7H10N4/c1-2-3-6-10-5(4-8)7(9)11-6/h2-3,9H2,1H3,(H,10,11)
    • InChI Key: BYBSLZJTPXIDGW-UHFFFAOYSA-N
    • SMILES: N1C(C#N)=C(N)N=C1CCC

Computed Properties

  • Exact Mass: 150.091
  • Monoisotopic Mass: 150.091
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 171
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 78.5A^2
  • XLogP3: 1.5
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